CID 71758524

1-(2-methoxyethyl)cyclobutane-1-carbaldehyde

Structural Information

Molecular Formula
C8H14O2
SMILES
COCCC1(CCC1)C=O
InChI
InChI=1S/C8H14O2/c1-10-6-5-8(7-9)3-2-4-8/h7H,2-6H2,1H3
InChIKey
BSFIBIXKRUIEAD-UHFFFAOYSA-N
Compound name
1-(2-methoxyethyl)cyclobutane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

142.09938 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 128.0
[M+Na]+ 165.088598 134.0
[M-H]- 141.092104 131.7
[M+NH4]+ 160.133203 145.1
[M+K]+ 181.062538 136.6
[M+H-H2O]+ 125.096640 119.4
[M+HCOO]- 187.097581 150.3
[M+CH3COO]- 201.113231 177.5
[M+Na-2H]- 163.074046 135.1
[M]+ 142.09883142 138.3
[M]- 142.09992858 138.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe